#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1boe n LEU 14 N 0.00 -2.07 0.00 0.00 4.32 -1.26 -4.35 117.00 113.64 1boe n LEU 14 Ca 0.00 -0.22 0.00 0.00 -0.02 0.00 0.00 56.01 55.77 1boe n LEU 14 Cb 0.00 -1.05 0.00 0.00 -1.62 0.00 0.00 43.42 40.75 1boe n LEU 14 CO 0.00 -3.28 0.00 0.00 -1.22 0.00 0.00 177.39 172.89 1boe n ALA 15 N -4.76 0.00 -2.79 -1.18 0.00 -1.26 -0.43 120.51 110.09 1boe n ALA 15 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.10 1boe n ALA 15 Cb 0.58 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.93 1boe n ALA 15 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1boe s GLU 16 N 3.18 3.94 0.00 0.00 -6.30 -1.26 -4.24 118.70 114.01 1boe s GLU 16 Ca 0.00 -0.34 0.00 0.00 -2.50 0.00 0.00 54.97 52.13 1boe s GLU 16 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 34.13 30.73 1boe s GLU 16 CO 0.00 0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.75 1boe n GLY 17 N 4.24 0.43 3.76 -1.50 0.00 -0.77 -4.98 105.19 106.37 1boe n GLY 17 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1boe n GLY 17 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1boe s GLN 18 N -0.90 4.53 -0.16 1.61 -0.44 -1.26 -4.74 119.66 118.30 1boe s GLN 18 Ca 0.00 1.95 -0.29 0.00 -2.50 0.00 0.00 55.36 54.52 1boe s GLN 18 Cb 0.00 -3.15 -0.03 0.00 -1.64 0.00 0.00 33.01 28.19 1boe s GLN 18 CO 0.00 0.04 1.43 -1.12 0.50 0.00 0.00 175.29 176.15 1boe s SER 19 N -0.63 6.74 0.00 6.67 0.01 -1.26 -2.89 113.70 122.34 1boe s SER 19 Ca 0.47 1.77 0.00 0.00 1.31 0.00 0.00 55.95 59.50 1boe s SER 19 Cb -0.35 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.35 1boe s SER 19 CO 0.45 -0.93 0.00 0.00 0.41 0.00 0.00 173.24 173.16 1boe s GLY 21 N 0.00 -0.25 0.64 0.00 0.00 -1.26 0.17 107.32 106.62 1boe s GLY 21 Ca 0.00 2.20 0.27 0.00 0.00 0.00 0.00 44.72 47.19 1boe s GLY 21 CO 0.00 1.29 1.82 -0.39 0.00 0.00 0.00 173.10 175.82 1boe h VAL 22 N 2.93 0.14 -0.58 1.40 -1.51 0.37 1.92 116.25 120.91 1boe h VAL 22 Ca -0.22 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 1boe h VAL 22 Cb 1.17 0.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1boe h VAL 22 CO 0.25 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.37 1boe n TYR 23 N -3.18 1.51 0.00 5.19 4.01 -1.22 -4.85 117.16 118.62 1boe n TYR 23 Ca 0.03 -0.58 0.00 0.00 -0.16 0.00 0.00 57.90 57.19 1boe n TYR 23 Cb 0.57 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 1boe n TYR 23 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1boe n THR 24 N 0.93 0.00 -3.42 -0.72 -1.04 0.65 -5.01 114.28 105.67 1boe n THR 24 Ca 0.24 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.05 1boe n THR 24 Cb 0.90 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.40 1boe n THR 24 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1boe s GLU 25 N 3.26 2.53 -0.92 -2.82 0.41 -1.26 -4.99 118.70 114.91 1boe s GLU 25 Ca 0.00 -1.55 -0.20 0.00 -0.41 0.00 0.00 54.97 52.81 1boe s GLU 25 Cb 0.00 -2.46 0.11 0.00 -1.78 0.00 0.00 34.13 30.00 1boe s GLU 25 CO 0.00 -0.35 1.17 -0.98 -0.49 0.00 0.00 175.26 174.61 1boe s ARG 26 N -4.27 3.54 1.01 1.61 3.03 -1.26 -4.80 118.95 117.83 1boe s ARG 26 Ca 0.50 -1.53 -0.21 0.00 2.03 0.00 0.00 55.73 56.51 1boe s ARG 26 Cb -0.05 -4.93 -0.11 0.00 -1.03 0.00 0.00 34.95 28.84 1boe s ARG 26 CO 0.30 -1.86 -0.85 0.00 -1.13 0.00 0.00 175.30 171.75 1boe n ALA 28 N -3.33 -1.83 -1.30 0.00 0.00 0.42 -4.34 120.51 110.13 1boe n ALA 28 Ca -0.01 0.25 -0.51 0.00 0.00 0.00 0.00 53.44 53.18 1boe n ALA 28 Cb 0.65 -0.74 -0.07 0.00 0.00 0.00 0.00 19.45 19.29 1boe n ALA 28 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1boe n GLN 29 N 0.63 0.00 0.00 0.00 7.27 -1.26 0.16 117.38 124.18 1boe n GLN 29 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.15 1boe n GLN 29 Cb 0.04 -1.22 0.00 0.00 2.41 0.00 0.00 30.24 31.46 1boe n GLN 29 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1boe n GLY 30 N 1.99 3.08 3.84 1.69 0.00 -1.26 -5.03 105.19 109.51 1boe n GLY 30 Ca 0.20 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 1boe n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1boe s LEU 31 N 0.00 3.59 0.01 0.99 1.43 0.43 -3.12 118.68 122.01 1boe s LEU 31 Ca 0.00 1.56 -0.12 0.00 -1.03 0.00 0.00 54.13 54.54 1boe s LEU 31 Cb 0.00 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.73 1boe s LEU 31 CO 0.00 -0.62 0.25 -0.13 0.23 0.00 0.00 176.35 176.08 1boe s ARG 32 N -4.17 0.66 -0.47 1.70 0.52 -1.22 -4.32 118.95 111.66 1boe s ARG 32 Ca 0.59 -0.39 -0.27 0.00 -0.52 0.00 0.00 55.73 55.13 1boe s ARG 32 Cb -0.10 0.28 -0.02 0.00 0.52 0.00 0.00 34.95 35.63 1boe s ARG 32 CO 0.33 -0.19 1.84 0.00 0.02 0.00 0.00 175.30 177.31 1boe s LEU 34 N 8.08 2.63 -1.18 0.00 2.01 0.16 -4.29 118.68 126.11 1boe s LEU 34 Ca 0.74 -0.82 -0.07 0.00 0.01 0.00 0.00 54.13 53.99 1boe s LEU 34 Cb -0.17 -1.30 -0.07 0.00 0.01 0.00 0.00 46.19 44.65 1boe s LEU 34 CO 0.27 0.10 2.51 -0.81 1.01 0.00 0.00 176.35 179.43 1boe n PRO 35 N -0.01 2.75 -3.92 1.29 -0.04 -1.26 -0.39 135.00 133.43 1boe n PRO 35 Ca -0.10 -1.74 -0.22 0.00 -0.04 0.00 0.00 63.50 61.40 1boe n PRO 35 Cb 0.57 -2.57 -0.04 0.00 -0.04 0.00 0.00 33.50 31.41 1boe n PRO 35 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1boe s ARG 36 N 2.79 2.65 -0.97 0.54 1.81 -1.26 -4.50 118.95 120.02 1boe s ARG 36 Ca 0.53 -1.33 -0.08 0.00 -1.72 0.00 0.00 55.73 53.13 1boe s ARG 36 Cb 0.14 -2.41 0.07 0.00 -0.45 0.00 0.00 34.95 32.30 1boe s ARG 36 CO -0.04 0.13 0.29 1.04 -0.68 0.00 0.00 175.30 176.04 1boe n GLN 37 N -1.29 -2.66 -2.59 3.54 1.13 -1.26 -3.78 117.38 110.47 1boe n GLN 37 Ca -0.03 0.30 -0.25 0.00 -1.94 0.00 0.00 57.00 55.08 1boe n GLN 37 Cb 0.60 -4.91 -0.00 0.00 0.11 0.00 0.00 30.24 26.04 1boe n GLN 37 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1boe n ASP 38 N -2.01 4.23 0.22 1.08 -0.08 -1.26 -4.83 116.55 113.90 1boe n ASP 38 Ca -0.01 -3.59 0.13 0.00 -1.51 0.00 0.00 54.79 49.81 1boe n ASP 38 Cb 0.52 -0.49 0.69 0.00 2.34 0.00 0.00 41.12 44.19 1boe n ASP 38 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1boe h GLU 39 N 2.70 0.00 -5.21 -0.67 4.57 -1.94 -2.84 114.58 111.20 1boe h GLU 39 Ca 0.22 0.00 -0.69 0.00 -1.18 0.00 0.00 59.36 57.71 1boe h GLU 39 Cb 0.88 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 29.32 1boe h GLU 39 CO 0.80 0.00 1.35 -1.21 -1.18 0.00 0.00 179.01 178.77 1boe s GLU 40 N -3.69 3.85 -0.45 1.92 8.01 -1.26 -4.35 118.70 122.73 1boe s GLU 40 Ca -0.03 -2.03 -0.01 0.00 0.01 0.00 0.00 54.97 52.92 1boe s GLU 40 Cb 0.07 -5.14 -0.01 0.00 -4.31 0.00 0.00 34.13 24.75 1boe s GLU 40 CO 0.23 -1.91 0.41 1.63 0.01 0.00 0.00 175.26 175.63 1boe n LYS 41 N 6.83 -0.86 -1.70 1.61 5.02 -1.25 -4.98 118.16 122.83 1boe n LYS 41 Ca 0.34 0.84 -0.28 0.00 -2.02 0.00 0.00 58.31 57.19 1boe n LYS 41 Cb 0.46 -3.77 0.20 0.00 -0.02 0.00 0.00 35.03 31.91 1boe n LYS 41 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1boe n PRO 42 N -1.74 -1.50 -1.73 1.97 -0.04 -1.07 -4.00 135.00 126.89 1boe n PRO 42 Ca -0.01 -1.92 -0.15 0.00 -0.04 0.00 0.00 63.50 61.37 1boe n PRO 42 Cb 0.52 -1.35 -0.05 0.00 -0.04 0.00 0.00 33.50 32.59 1boe n PRO 42 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1boe n LEU 43 N 0.00 -1.21 -2.09 1.53 4.77 -1.26 -4.60 117.00 114.14 1boe n LEU 43 Ca 0.16 0.31 -0.02 0.00 -0.03 0.00 0.00 56.01 56.43 1boe n LEU 43 Cb 0.55 -2.30 0.00 0.00 -2.33 0.00 0.00 43.42 39.35 1boe n LEU 43 CO 0.40 -0.62 0.44 1.57 -1.33 0.00 0.00 177.39 177.85 1boe n HIS 44 N -2.47 -0.34 0.00 -1.77 -0.00 -1.26 -5.02 115.22 104.36 1boe n HIS 44 Ca -0.16 -0.45 0.00 0.00 0.46 0.00 0.00 57.72 57.57 1boe n HIS 44 Cb 0.54 0.90 0.00 0.00 -0.12 0.00 0.00 29.99 31.32 1boe n HIS 44 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1boe n ALA 45 N -0.35 2.61 0.90 1.57 0.00 -1.26 -4.80 120.51 119.19 1boe n ALA 45 Ca -0.13 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.36 1boe n ALA 45 Cb 0.59 0.09 0.29 0.00 0.00 0.00 0.00 19.45 20.43 1boe n ALA 45 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1boe n LEU 46 N -2.24 0.00 -0.04 0.00 -0.00 -1.26 -0.33 117.00 113.12 1boe n LEU 46 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1boe n LEU 46 Cb 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.51 1boe n LEU 46 CO 0.00 0.00 -0.11 -0.07 -0.00 0.00 0.00 177.39 177.21 1boe h LEU 47 N 0.00 0.00 -0.17 1.47 3.38 -1.87 2.29 115.31 120.41 1boe h LEU 47 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1boe h LEU 47 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1boe h LEU 47 CO 0.00 0.45 -0.03 0.45 0.09 0.00 0.00 178.44 179.39 1boe h HIS 48 N -0.73 0.36 0.00 1.13 3.86 -1.91 -3.23 115.15 114.64 1boe h HIS 48 Ca 0.00 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1boe h HIS 48 Cb 0.17 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.55 1boe h HIS 48 CO -0.07 0.58 0.00 0.41 0.86 0.00 0.00 177.93 179.71 1boe n GLY 49 N -0.16 0.00 0.26 2.45 0.00 -1.17 -4.73 105.19 101.83 1boe n GLY 49 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.98 1boe n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1boe n ARG 50 N 0.00 0.21 -1.69 1.61 5.12 0.25 -4.45 116.66 117.71 1boe n ARG 50 Ca 0.00 -0.93 -0.11 0.00 -1.93 0.00 0.00 57.85 54.88 1boe n ARG 50 Cb 0.00 -0.58 0.05 0.00 -1.16 0.00 0.00 32.46 30.77 1boe n ARG 50 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1boe n GLY 51 N -0.11 0.99 3.19 -0.13 0.00 0.45 -4.39 105.19 105.20 1boe n GLY 51 Ca 0.01 -2.04 -0.26 0.00 0.00 0.00 0.00 46.02 43.73 1boe n GLY 51 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1boe s VAL 52 N -1.29 1.54 -0.44 1.61 -7.23 0.48 0.23 120.40 115.30 1boe s VAL 52 Ca 0.33 -0.82 -0.29 0.00 -1.81 0.00 0.00 61.98 59.39 1boe s VAL 52 Cb -0.02 -1.29 0.03 0.00 0.56 0.00 0.00 36.38 35.66 1boe s VAL 52 CO 0.21 0.44 1.11 0.00 -0.31 0.00 0.00 175.10 176.55 1boe s LEU 54 N 4.25 3.51 0.81 0.00 1.98 -0.98 -1.84 118.68 126.40 1boe s LEU 54 Ca 0.47 -0.14 -0.17 0.00 -2.89 0.00 0.00 54.13 51.39 1boe s LEU 54 Cb -0.08 -2.21 -0.12 0.00 0.66 0.00 0.00 46.19 44.43 1boe s LEU 54 CO 0.28 0.18 -0.33 0.59 -1.89 0.00 0.00 176.35 175.18 1boe n ASN 55 N 0.63 -4.39 -2.12 3.68 3.02 -1.26 -3.44 115.26 111.39 1boe n ASN 55 Ca -0.11 0.39 -0.21 0.00 -0.03 0.00 0.00 54.58 54.62 1boe n ASN 55 Cb 0.52 -0.88 0.01 0.00 -0.61 0.00 0.00 39.78 38.82 1boe n ASN 55 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1boe n GLU 56 N 1.44 2.05 0.00 3.52 -0.00 -1.18 -4.53 120.64 121.94 1boe n GLU 56 Ca 0.03 -1.93 0.00 0.00 -0.00 0.00 0.00 57.16 55.27 1boe n GLU 56 Cb 0.52 -1.83 0.00 0.00 -0.00 0.00 0.00 31.44 30.13 1boe n GLU 56 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1boe n LYS 57 N 0.45 0.00 0.00 3.44 5.02 -1.26 -5.09 118.16 120.72 1boe n LYS 57 Ca 0.38 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.72 1boe n LYS 57 Cb 0.58 -0.08 0.27 0.00 -0.02 0.00 0.00 35.03 35.77 1boe n LYS 57 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31